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1087797-71-4 | N-cyclooctyl-1H-imidazole-1-carboxamide
CAS No: 1087797-71-4 Catalog No: AG019QPY MDL No:MFCD11099686
Product Description
Catalog Number:
AG019QPY
Chemical Name:
N-cyclooctyl-1H-imidazole-1-carboxamide
CAS Number:
1087797-71-4
Molecular Formula:
C12H19N3O
Molecular Weight:
221.2988
MDL Number:
MFCD11099686
IUPAC Name:
N-cyclooctylimidazole-1-carboxamide
InChI:
InChI=1S/C12H19N3O/c16-12(15-9-8-13-10-15)14-11-6-4-2-1-3-5-7-11/h8-11H,1-7H2,(H,14,16)
InChI Key:
NQIRTZQXJHWDOP-UHFFFAOYSA-N
SMILES:
O=C(n1cncc1)NC1CCCCCCC1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.153g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.304g/mol
Monoisotopic Mass:
221.153g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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